5-O-Caffeoylshikimic acid
Molecular Formula:
C16H16O8
InChI: InChI=1/C16H16O8/c17-10-3-1-8(5-11(10)18)2-4-14(20)24-13-7-9(16(22)23)6-12(19)15(13)21/h1-6,12-13,15,17-19,21H,7H2,(H,22,23)/b4-2+/t12-,13-,15-/m1/s1/f/h22H
InChIKey: InChIKey=QMPHZIPNNJOWQI-YCLZJAPZDW
SMILES: C1C(C(C(C=C1C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O
Names:
C10434
(3R,4R,5R)-5-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4-dihydroxy-cyclohexene-1-carboxylic acid
5-O-Caffeoylshikimic acid
73263-62-4
Registries:
PubChem CID 5281762
PubChem ID 12619
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